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1,3-benzothiazol-2-ylmethyl 3-(phenylsulfonylamino)propanoate

1,3-benzothiazol-2-ylmethyl 3-(phenylsulfonylamino)propanoate

Systemtic Name:1,3-benzothiazol-2-ylmethyl 3-(phenylsulfonylamino)propanoate
Openeye Name:1,3-benzothiazol-2-ylmethyl 3-(benzenesulfonamido)propanoate
CAS Name:3-(benzenesulfonamido)propanoic acid 1,3-benzothiazol-2-ylmethyl ester
IUPAC Name:1,3-benzothiazol-2-ylmethyl 3-(benzenesulfonamido)propanoate
Traditional Name:3-(benzenesulfonamido)propionic acid 1,3-benzothiazol-2-ylmethyl ester
Formula: C17H16N2O4S2
MolecularWeight: 376.44994
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=NC3=CC=CC=C3S2


Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=NC3=CC=CC=C3S2


InChI

InChI=1S/C17H16N2O4S2/c20-17(10-11-18-25(21,22)13-6-2-1-3-7-13)23-12-16-19-14-8-4-5-9-15(14)24-16/h1-9,18H,10-12H2


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